8602-0073 Screening compound: N-[1-butyl-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl]-4-methylbenzamide

8602-0073 Screening compound: N-[1-butyl-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl]-4-methylbenzamide
8602-0073 Screening compound: N-[1-butyl-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl]-4-methylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8602-0073
N-[1-butyl-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl]-4-methylbenzamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

8602-0073

Molecular Formula

C16H18F3N3O3 (C16 H18 F3 N3 O3)

Compound Name

N-[1-butyl-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl]-4-methylbenzamide

IUPAC name

N-[1-butyl-25-dioxo-4-(trifluoromethyl)imidazolidin-4-yl]-4-methylbenzamide

SMILES

CCCCN(C(C(C(F)(F)F)(NC(c1ccc(C)cc1)=O)N1)=O)C1=O

InChI

InChI=1S/C16H18F3N3O3/c1-3-4-9-22-13(24)15(16(17,18)19,21-14(22)25)20-12(23)11-7-5-10(2)6-8-11/h5-8H,3-4,9H2,1-2H3,(H,20,23)(H,21,25)/t15-/m1/s1

InChI Key

QBVBRXVZBXRCLF-OAHLLOKOSA-N

MDL Number (MFCD)

MFCD06007855

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

357.33

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.050

Distribution Coefficient, logD

0.641

Water Solubility, LogSw

-3.15

Polar Surface Area

66.047

Acid Dissociation Constant (pKa)

4.99

Base Dissociation Constant (pKb)

-5.97

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

43.80

References: we are preparing a list of scientific research reports with 8602-0073 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8602-0073?
Check Price and Availability of 8602-0073, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 8602-0073 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8602-0073
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8602-0073
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 8602-0073 available by request